7-(3,4-dimethoxyphenyl)-5-(hydroxymethyl)-2-methanoyl-4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-6-carboxylic acid

Systemtic Name: 7-(3,4-dimethoxyphenyl)-5-(hydroxymethyl)-2-methanoyl-4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-6-carboxylic acid Openeye Name: 7-(3,4-dimethoxyphenyl)-2-formyl-5-(hydroxymethyl)-4-oxo-6,7-dihydro-5H-benzofuran-6-carboxylic acid CAS Name: 7-(3,4-dimethoxyphenyl)-2-formyl-5-(hydroxymethyl)-4-oxo-6,7-dihydro-5H-benzofuran-6-carboxylic acid IUPAC Name: 7-(3,4-dimethoxyphenyl)-2-formyl-5-(hydroxymethyl)-4-oxo-6,7-dihydro-5H-1-benzofuran-6-carboxylic acid Traditional Name: 7-(3,4-dimethoxyphenyl)-2-formyl-4-keto-5-methylol-6,7-dihydro-5H-benzofuran-6-carboxylic acid Formula: C19H18O8 MolecularWeight: 374.34142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(C(C(=O)C3=C2OC(=C3)C=O)CO)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2C(C(C(=O)C3=C2OC(=C3)C=O)CO)C(=O)O)OC

InChI

InChI=1S/C19H18O8/c1-25-13-4-3-9(5-14(13)26-2)15-16(19(23)24)12(8-21)17(22)11-6-10(7-20)27-18(11)15/h3-7,12,15-16,21H,8H2,1-2H3,(H,23,24)